[2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] 2-[methyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]amino]ethanoate

Systemtic Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] 2-[methyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]amino]ethanoate Openeye Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] 2-[[2-(tert-butoxycarbonylamino)acetyl]-methyl-amino]acetate CAS Name: 2-[methyl-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]acetic acid [2-(6-imidazo[1,2-a]pyridinyl)-2-[methylamino(sulfanylidene)methyl]cyclohexyl] ester IUPAC Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] 2-[methyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]acetate Traditional Name: 2-[[2-(tert-butoxycarbonylamino)acetyl]-methyl-amino]acetic acid [2-imidazo[1,2-a]pyridin-6-yl-2-(methylthiocarbamoyl)cyclohexyl] ester Formula: C25H35N5O5S MolecularWeight: 517.6409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)N(C)CC(=O)OC1CCCCC1(C2=CN3C=CN=C3C=C2)C(=S)NC

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)N(C)CC(=O)OC1CCCCC1(C2=CN3C=CN=C3C=C2)C(=S)NC

InChI

InChI=1S/C25H35N5O5S/c1-24(2,3)35-23(33)28-14-20(31)29(5)16-21(32)34-18-8-6-7-11-25(18,22(36)26-4)17-9-10-19-27-12-13-30(19)15-17/h9-10,12-13,15,18H,6-8,11,14,16H2,1-5H3,(H,26,36)(H,28,33)